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Related entries of code: 2d0k
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1dhiRCSB PDB    PDBbind159aa, >1DHI_1|Chains... *
1dhjRCSB PDB    PDBbind159aa, >1DHJ_1|Chains... at 99%
2drcRCSB PDB    PDBbind159aa, >2DRC_1|Chains... at 98%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
4kmzRCSB PDB    PDBbindFOL
4lrhRCSB PDB    PDBbindFOL
4z7fRCSB PDB    PDBbindFOL
Entry Information
PDB ID2d0k
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein Namedihydrofolate reductase
Ligand NameFOL
EC.Number E.C.1.5.1.3
Resolution 1.9(Å)
Affinity (Kd/Ki/IC50)Kd=9.51uM
Release Year2006
Protein/NA SequenceCheck fasta file
Primary Reference J.Biol.Chem. v281 pp. 13234-46, 2006
Ligand Properties
Formula C19H19N7O6
Molecular Weight 441.397
Exact Mass 441.140
No. of atoms 51
No. of bonds 53
Polar Surface Area 213.28
LOGP Value 1.25      (Computed with XLOGP3)
1.00      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 8
No. of Rotatable Bonds: 8
No. of Nitrogen and Oxygen Atoms: 13
No. of Rings: 3
Canonical SMILES
InChI String

Links to External Databases
RCSB PDBThe mother database
PDBsumEnhanced annotations on PDB entries
PubchemComprehensive collection of chemical and biological data
UniProtKB ACUniProt accession number (AC): P0ABQ4  
Entrez Gene IDNCBI Entrez Gene ID: 61752704  944790  
ASDInformation of known allosteric effects of PDB entries
 
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